2-[[(4-fluoranyl-3-methyl-phenyl)amino]-methylsulfanyl-methylidene]propanedinitrile

Systemtic Name: 2-[[(4-fluoranyl-3-methyl-phenyl)amino]-methylsulfanyl-methylidene]propanedinitrile Openeye Name: 2-[(4-fluoro-3-methyl-anilino)-methylsulfanyl-methylene]propanedinitrile CAS Name: 2-[(4-fluoro-3-methylanilino)-(methylthio)methylidene]propanedinitrile IUPAC Name: 2-[(4-fluoro-3-methylanilino)-methylsulfanylmethylidene]propanedinitrile Traditional Name: 2-[(4-fluoro-3-methyl-anilino)-(methylthio)methylene]malononitrile Formula: C12H10FN3S MolecularWeight: 247.291303

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=C1)NC(=C(C#N)C#N)SC)F

Isomeric SMILES

CC1=C(C=CC(=C1)NC(=C(C#N)C#N)SC)F

InChI

InChI=1S/C12H10FN3S/c1-8-5-10(3-4-11(8)13)16-12(17-2)9(6-14)7-15/h3-5,16H,1-2H3